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Ambroise van Roekeghem

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2020 – today

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2021
[j3]
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  - journals/cphysics/RoekeghemCM21
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Ambroise van Roekeghem, Jesús Carrete, Natalio Mingo:
Quantum Self-Consistent Ab-Initio Lattice Dynamics. Comput. Phys. Commun. 263: 107945 (2021)

2010 – 2019

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2018
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Fleur Legrain, Ambroise van Roekeghem, Stefano Curtarolo, Jesús Carrete, Georg K. H. Madsen, Natalio Mingo:
Vibrational Properties of Metastable Polymorph Structures by Machine Learning. J. Chem. Inf. Model. 58(12): 2460-2466 (2018)
2017
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Jesús Carrete, Bjorn Vermeersch, Ankita Katre, Ambroise van Roekeghem, Tao Wang, Georg K. H. Madsen, Natalio Mingo:
almaBTE : A solver of the space-time dependent Boltzmann transport equation for phonons in structured materials. Comput. Phys. Commun. 220: 351-362 (2017)

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